N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine

C13H20N2O — CID 106660273

IUPACN-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine
SMILESCOc1cnc(C)cc1NCC1CCCC1
InChIInChI=1S/C13H20N2O/c1-10-7-12(13(16-2)9-14-10)15-8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,14,15)
InChIKeyCTOTZHWUPNWOJY-UHFFFAOYSA-N
MW220.32 g/mol
LogP3.00
Rot. Bonds4

About N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine

N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine (PubChem CID 106660273) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine
PubChem CID106660273
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine
SMILESCOc1cnc(C)cc1NCC1CCCC1
InChIInChI=1S/C13H20N2O/c1-10-7-12(13(16-2)9-14-10)15-8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,14,15)
InChIKeyCTOTZHWUPNWOJY-UHFFFAOYSA-N
XLogP3.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine?
The IUPAC name of N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine (CID 106660273) is N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine?
The canonical SMILES for N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine is COc1cnc(C)cc1NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine?
The InChIKey is CTOTZHWUPNWOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-7-12(13(16-2)9-14-10)15-8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,14,15).
What are the key properties of N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine?
N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine is sourced from PubChem (CID 106660273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).